(E)-3-(4-chloranyl-3-nitro-phenyl)-N-(3-nitro-4-piperazin-1-yl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-N-(3-nitro-4-piperazin-1-yl-phenyl)prop-2-enamide Openeye Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-(3-nitro-4-piperazin-1-yl-phenyl)prop-2-enamide CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-N-[3-nitro-4-(1-piperazinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(4-chloro-3-nitrophenyl)-N-(3-nitro-4-piperazin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-(3-nitro-4-piperazino-phenyl)acrylamide Formula: C19H18ClN5O5 MolecularWeight: 431.82972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)NC(=O)/C=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H18ClN5O5/c20-15-4-1-13(11-17(15)24(27)28)2-6-19(26)22-14-3-5-16(18(12-14)25(29)30)23-9-7-21-8-10-23/h1-6,11-12,21H,7-10H2,(H,22,26)/b6-2+